5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C22H26ClN5O3S MolecularWeight: 475.99154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NN=C(S3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NN=C(S3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H26ClN5O3S/c23-16-6-5-7-17(14-16)24-18(29)19-25-26-20(32-19)22(31)28-12-8-15(9-13-28)21(30)27-10-3-1-2-4-11-27/h5-7,14-15H,1-4,8-13H2,(H,24,29)